MMs01027172 MOE2007 2D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2948 0.7573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0147 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5980 1.2147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6065 -1.4853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8928 0.7721 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2046 -1.4705 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4908 0.7868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8646 0.1845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8620 1.3049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3619 1.3134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1046 2.6166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3472 3.9114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8472 3.9029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1046 2.5996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6392 2.2794 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7429 3.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0898 5.2147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1848 -1.2810 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.6140 -1.7364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9341 -3.2018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3633 -3.6573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4723 -2.6473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1522 -1.1818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7230 -0.7264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9015 -3.1027 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.6059 1.0358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0358 -0.6059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6059 -1.0358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5182 1.6722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0609 1.6810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4066 -1.4921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6133 -2.6852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8065 -1.4785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8860 1.9721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9678 0.2775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3045 2.6234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2414 4.9387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1324 4.6206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6839 6.2573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0472 5.8088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0469 -4.0098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6195 -4.8296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0394 -0.3738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4668 0.4459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 M END